Exploring the charge localization and band gap opening of borophene: A first-principles study

10.1039/c7nr06537j

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Bibliographic Details
Main Authors:	Kistanov, A.A, Cai, Y, Zhou, K, Srikanth, N, Dmitriev, S.V, Zhang, Y.-W
Other Authors:	MATERIALS SCIENCE AND ENGINEERING
Format:	Article
Published:	Royal Society of Chemistry 2020
Subjects:	Calculations Charge transfer Electronic structure Fluorine Sulfur compounds Charge delocalization Charge localization Chemical functionalization First-principles calculation First-principles study Functionalizations Orbital hybridization Two Dimensional (2 D) Energy gap
Online Access:	https://scholarbank.nus.edu.sg/handle/10635/178541
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Institution:	National University of Singapore

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spelling	sg-nus-scholar.10635-1785412024-04-25T01:01:53Z Exploring the charge localization and band gap opening of borophene: A first-principles study Kistanov, A.A Cai, Y Zhou, K Srikanth, N Dmitriev, S.V Zhang, Y.-W MATERIALS SCIENCE AND ENGINEERING Calculations Charge transfer Electronic structure Fluorine Sulfur compounds Charge delocalization Charge localization Chemical functionalization First-principles calculation First-principles study Functionalizations Orbital hybridization Two Dimensional (2 D) Energy gap 10.1039/c7nr06537j Nanoscale 10 3 1403-1410 2020-10-20T10:13:44Z 2020-10-20T10:13:44Z 2018 Article Kistanov, A.A, Cai, Y, Zhou, K, Srikanth, N, Dmitriev, S.V, Zhang, Y.-W (2018). Exploring the charge localization and band gap opening of borophene: A first-principles study. Nanoscale 10 (3) : 1403-1410. ScholarBank@NUS Repository. https://doi.org/10.1039/c7nr06537j 2040-3364 https://scholarbank.nus.edu.sg/handle/10635/178541 Attribution 4.0 International http://creativecommons.org/licenses/by/4.0/ Royal Society of Chemistry Unpaywall 20201031
institution	National University of Singapore
building	NUS Library
continent	Asia
country	Singapore Singapore
content_provider	NUS Library
collection	ScholarBank@NUS
topic	Calculations Charge transfer Electronic structure Fluorine Sulfur compounds Charge delocalization Charge localization Chemical functionalization First-principles calculation First-principles study Functionalizations Orbital hybridization Two Dimensional (2 D) Energy gap
spellingShingle	Calculations Charge transfer Electronic structure Fluorine Sulfur compounds Charge delocalization Charge localization Chemical functionalization First-principles calculation First-principles study Functionalizations Orbital hybridization Two Dimensional (2 D) Energy gap Kistanov, A.A Cai, Y Zhou, K Srikanth, N Dmitriev, S.V Zhang, Y.-W Exploring the charge localization and band gap opening of borophene: A first-principles study
description	10.1039/c7nr06537j
author2	MATERIALS SCIENCE AND ENGINEERING
author_facet	MATERIALS SCIENCE AND ENGINEERING Kistanov, A.A Cai, Y Zhou, K Srikanth, N Dmitriev, S.V Zhang, Y.-W
format	Article
author	Kistanov, A.A Cai, Y Zhou, K Srikanth, N Dmitriev, S.V Zhang, Y.-W
author_sort	Kistanov, A.A
title	Exploring the charge localization and band gap opening of borophene: A first-principles study
title_short	Exploring the charge localization and band gap opening of borophene: A first-principles study
title_full	Exploring the charge localization and band gap opening of borophene: A first-principles study
title_fullStr	Exploring the charge localization and band gap opening of borophene: A first-principles study
title_full_unstemmed	Exploring the charge localization and band gap opening of borophene: A first-principles study
title_sort	exploring the charge localization and band gap opening of borophene: a first-principles study
publisher	Royal Society of Chemistry
publishDate	2020
url	https://scholarbank.nus.edu.sg/handle/10635/178541
_version_	1800914507689623552

Exploring the charge localization and band gap opening of borophene: A first-principles study

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